2-[4-(3-azanyl-3-methanoyl-4-methyl-2-oxidanylidene-pentyl)-2,3-bis(oxidanylidene)piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-(3-azanyl-3-methanoyl-4-methyl-2-oxidanylidene-pentyl)-2,3-bis(oxidanylidene)piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-(3-amino-3-formyl-4-methyl-2-oxo-pentyl)-2,3-dioxo-piperazin-1-yl]acetic acid CAS Name: 2-[4-(3-amino-3-formyl-4-methyl-2-oxopentyl)-2,3-dioxo-1-piperazinyl]acetic acid IUPAC Name: 2-[4-(3-amino-3-formyl-4-methyl-2-oxopentyl)-2,3-dioxopiperazin-1-yl]acetic acid Traditional Name: 2-[4-(3-amino-3-formyl-2-keto-4-methyl-pentyl)-2,3-diketo-piperazino]acetic acid Formula: C13H19N3O6 MolecularWeight: 313.30646

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C=O)(C(=O)CN1CCN(C(=O)C1=O)CC(=O)O)N

Isomeric SMILES

CC(C)C(C=O)(C(=O)CN1CCN(C(=O)C1=O)CC(=O)O)N

InChI

InChI=1S/C13H19N3O6/c1-8(2)13(14,7-17)9(18)5-15-3-4-16(6-10(19)20)12(22)11(15)21/h7-8H,3-6,14H2,1-2H3,(H,19,20)